5,6-Dichloro-1-ribofuranosylbenzimidazole 5'-monophosphate
TL;DR: 5,6-Dichloro-1-ribofuranosylbenzimidazole 5'-monophosphate (CAS 72586-79-9) is a chemical compound with molecular formula C12H13Cl2N2O7P and molecular weight 397.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,3S,4R,5R)-5-(5,6-dichlorobenzimidazol-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate
Also Known As: Dcrfb-5'-monophosphate, 5,6-Dichloro-1-ribofuranosylbenzimidazole 5'-monophosphate, [(2R,3S,4R,5R)-5-(5,6-dichlorobenzimidazol-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate, 1H-Benzimidazole, 5,6-dichloro-1-(5-O-phosphono-beta-D-ribofuranosyl)-, 5,6-Dichloro-1-(5-O-phosphono-beta-D-ribofuranosyl)-1H-1,3-benzimidazole
| Molecular Formula | C12H13Cl2N2O7P |
|---|---|
| Molecular Weight | 397.98 g/mol |
| LogP | -0.6 |
| Topological Polar Surface Area | 134.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 397.98373 |
| Heavy Atoms | 24 |
| Complexity | 512.0 |
Chemical Identifiers
| CAS Number | 72586-79-9 |
|---|---|
| SMILES | C1=C2C(=CC(=C1Cl)Cl)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O |
| InChIKey | SDRPYWMKLJILCQ-DDHJBXDOSA-N |
Product Overview
5,6-Dichloro-1-ribofuranosylbenzimidazole 5'-monophosphate (CAS 72586-79-9), with molecular formula C12H13Cl2N2O7P and molecular weight 397.98 g/mol. IUPAC: [(2R,3S,4R,5R)-5-(5,6-dichlorobenzimidazol-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate.
Chemical Property Profile of 5,6-Dichloro-1-ribofuranosylbenzimidazole 5'-monophosphate
Property Insights of 5,6-Dichloro-1-ribofuranosylbenzimidazole 5'-monophosphate
The XLogP value of -0.6 indicates that 5,6-Dichloro-1-ribofuranosylbenzimidazole 5'-monophosphate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 134.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5,6-Dichloro-1-ribofuranosylbenzimidazole 5'-monophosphate. Following Lipinski's Rule of Five, 5,6-Dichloro-1-ribofuranosylbenzimidazole 5'-monophosphate has 4 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5,6-Dichloro-1-ribofuranosylbenzimidazole 5'-monophosphate?
The CAS number of 5,6-Dichloro-1-ribofuranosylbenzimidazole 5'-monophosphate is 72586-79-9.
What is the molecular formula of 5,6-Dichloro-1-ribofuranosylbenzimidazole 5'-monophosphate?
The molecular formula of 5,6-Dichloro-1-ribofuranosylbenzimidazole 5'-monophosphate is C12H13Cl2N2O7P.
What is the molecular weight of 5,6-Dichloro-1-ribofuranosylbenzimidazole 5'-monophosphate?
The molecular weight of 5,6-Dichloro-1-ribofuranosylbenzimidazole 5'-monophosphate is 397.98 g/mol.
Where can I buy 5,6-Dichloro-1-ribofuranosylbenzimidazole 5'-monophosphate?
You can request a quote for 5,6-Dichloro-1-ribofuranosylbenzimidazole 5'-monophosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,6-Dichloro-1-ribofuranosylbenzimidazole 5'-monophosphate?
Yes, KEHONG BIO provides custom synthesis services for 5,6-Dichloro-1-ribofuranosylbenzimidazole 5'-monophosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.